2-[(4-chlorophenyl)carbamoylamino]-N-[2-fluoranyl-4-(N-methyl-N-prop-2-ynyl-carbamimidoyl)phenyl]-2-phenyl-ethanamide

Systemtic Name: 2-[(4-chlorophenyl)carbamoylamino]-N-[2-fluoranyl-4-(N-methyl-N-prop-2-ynyl-carbamimidoyl)phenyl]-2-phenyl-ethanamide Openeye Name: 2-[(4-chlorophenyl)carbamoylamino]-N-[2-fluoro-4-(N-methyl-N-prop-2-ynyl-carbamimidoyl)phenyl]-2-phenyl-acetamide CAS Name: 2-[[(4-chloroanilino)-oxomethyl]amino]-N-[2-fluoro-4-[imino-[methyl(prop-2-ynyl)amino]methyl]phenyl]-2-phenylacetamide IUPAC Name: 2-[(4-chlorophenyl)carbamoylamino]-N-[2-fluoro-4-(N-methyl-N-prop-2-ynylcarbamimidoyl)phenyl]-2-phenylacetamide Traditional Name: 2-[(4-chlorophenyl)carbamoylamino]-N-[2-fluoro-4-(N-methyl-N-propargyl-amidino)phenyl]-2-phenyl-acetamide Formula: C26H23ClFN5O2 MolecularWeight: 491.944523

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC#C)C(=N)C1=CC(=C(C=C1)NC(=O)C(C2=CC=CC=C2)NC(=O)NC3=CC=C(C=C3)Cl)F

Isomeric SMILES

CN(CC#C)C(=N)C1=CC(=C(C=C1)NC(=O)C(C2=CC=CC=C2)NC(=O)NC3=CC=C(C=C3)Cl)F

InChI

InChI=1S/C26H23ClFN5O2/c1-3-15-33(2)24(29)18-9-14-22(21(28)16-18)31-25(34)23(17-7-5-4-6-8-17)32-26(35)30-20-12-10-19(27)11-13-20/h1,4-14,16,23,29H,15H2,2H3,(H,31,34)(H2,30,32,35)